2-bromanyl-N-[1-[2-(4,6-dimethylpyrimidin-2-yl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[2-(4,6-dimethylpyrimidin-2-yl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[[(4,6-dimethylpyrimidin-2-yl)amino]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-[(4,6-dimethyl-2-pyrimidinyl)hydrazo]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-[2-(4,6-dimethylpyrimidin-2-yl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[[(4,6-dimethylpyrimidin-2-yl)amino]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C18H22BrN5O2S MolecularWeight: 452.36858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)NNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br)C

InChI

InChI=1S/C18H22BrN5O2S/c1-11-10-12(2)21-18(20-11)24-23-17(26)15(8-9-27-3)22-16(25)13-6-4-5-7-14(13)19/h4-7,10,15H,8-9H2,1-3H3,(H,22,25)(H,23,26)(H,20,21,24)